ChemicalBook--->CAS DataBase List--->175278-29-2

175278-29-2

175278-29-2 Structure

175278-29-2 Structure
IdentificationBack Directory
[Name]

METHYL 2-METHYL-5-FLUOROBENZOATE
[CAS]

175278-29-2
[Synonyms]

RARECHEM AL BF 0505
5-fluoro-2-methylbenzoate
METHYL 2-METHYL-5-FLUOROBENZOATE
METHYL 5-FLUORO-2-METHYLBENZOATE
Benzoic acid, 5-fluoro-2-methyl-, methyl ester
[Molecular Formula]

C9H9FO2
[MDL Number]

MFCD00221457
[MOL File]

175278-29-2.mol
[Molecular Weight]

168.16
Chemical PropertiesBack Directory
[Boiling point ]

90-92°C 15mm
[density ]

1.137±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

liquid
[color ]

Brown
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P271-P261-P280
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[Hazard Note ]

Irritant
[HS Code ]

2916399090
Hazard InformationBack Directory
[Uses]

Methyl 5-fluoro-2-methylbenzoate was used for the preparation of derivatives of piperidinedione.
[Synthesis]

5-Fluoro-2-methylbenzoic acid

33184-16-6

Iodomethane

74-88-4

Methyl 5-fluoro-2-methylbenzoate

175278-29-2

5-Fluoro-2-methylbenzoic acid (2.3 g) was dissolved in tetrahydrofuran (THF, 50 ml). To the solution, iodomethane (0.95 ml) and N,N-diisopropylethylamine (3.2 ml) were added sequentially. The reaction mixture was stirred at room temperature for 2 hours. After completion of the reaction, the mixture was filtered and the filtrate concentrated to give methyl 5-fluoro-2-methylbenzoate (2.3 g; 90% yield).1H-NMR (CDCl3) δ: 2.6 (s, 3H), 3.9 (s, 3H), 7.0-7.2 (m, 2H), 7.6-7.7 (m, 1H).

[References]

[1] Bioorganic and Medicinal Chemistry Letters, 2010, vol. 20, # 17, p. 5286 - 5289
[2] Patent: WO2006/116157, 2006, A2. Location in patent: Page/Page column 83-84
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 5-fluoro-2-methylbenzoate(175278-29-2)1HNMR
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